Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.44 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.44 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2859103 | 0.90 | EPHX2 (0.45) | TSHRALDH1A1NPSR1TAS1R3TAS1R1 | |
| SCHEMBL2850370 | 0.86 | DGAT2 (0.55) | TSHRALDH1A1NPSR1TAS1R3TAS1R1 | |
| SCHEMBL2853809 | 0.85 | P2RX7 (0.49) | TSHRALDH1A1NPSR1TAS1R3TAS1R1 | |
| SCHEMBL2853175 | 0.85 | KLKB1 (0.43) | TSHRALDH1A1NPSR1TAS1R3TAS1R1 | |
| SCHEMBL2852937 | 0.84 | KLKB1 (0.43) | TSHRALDH1A1NPSR1TAS1R3TAS1R1 | |
| SCHEMBL2855496 | 0.79 | KDM4E (0.46) | TSHRALDH1A1NPSR1KDM4EMAPK1 | |
| SCHEMBL2855714 | 0.77 | EPHX1 (0.45) | NPSR1MAPK1MEN1KMT2AMAPT | |
| SCHEMBL2856282 | 0.77 | DGAT2 (0.54) | TSHRALDH1A1NPSR1TAS1R3TAS1R1 | |
| SCHEMBL2850129 | 0.76 | ALDH1A1 (0.52) | ALDH1A1KDM4EMAPK1KMT2ACYP1A2 | |
| SCHEMBL2852117 | 0.76 | P2RX7 (0.48) | ALDH1A1MEN1KMT2AMAPTGAA |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1451160-B1 | PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN | ICAGEN INC (US) | 2010-01-13 | — | — | EP | claimed |